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3-Chloro-6-(phenylsulfanyl)bicyclo[3.1.1]hept-2-ene
SpectraBase Compound ID 12t7ixmZ5fI
InChI InChI=1S/C13H13ClS/c14-11-7-9-6-10(8-11)13(9)15-12-4-2-1-3-5-12/h1-5,7,9-10,13H,6,8H2/t9-,10+,13?/m0/s1
InChIKey QMLKIEYYEPYMST-RGPRDZHESA-N
Mol Weight 236.76 g/mol
Molecular Formula C13H13ClS
Exact Mass 236.042649 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2q5irqOta10
Name 3-CHLORO-endo-6-(PHENYLTHIO)BICYCLO[3.1.1]HEPT-2-ENE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H13ClS
InChI InChI=1S/C13H13ClS/c14-11-7-9-6-10(8-11)13(9)15-12-4-2-1-3-5-12/h1-5,7,9-10,13H,6,8H2/t9-,10+,13?/m0/s1
InChIKey QMLKIEYYEPYMST-RGPRDZHESA-N
Molecular Weight 236.0424
SMILES [C@]12(CC(Cl)=C[C@](C2)(C1Sc1ccccc1)[H])[H]
SPLASH splash10-006x-9510000000-33120813deb37572b697
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany